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3,5-Dimethoxy-4-hydroxy-benzoic acid, 4-guanidino-butyl ester cation

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3,5-Dimethoxy-4-hydroxy-benzoic acid, 4-guanidino-butyl ester cation
SpectraBase Compound ID 3Ohk9UCMgMt
InChI InChI=1S/C14H21N3O5/c1-20-10-7-9(8-11(21-2)12(10)18)13(19)22-6-4-3-5-17-14(15)16/h7-8,18H,3-6H2,1-2H3,(H4,15,16,17)/p+1
InChIKey WNGSUWLDMZFYNZ-UHFFFAOYSA-O
Mol Weight 312.35 g/mol
Molecular Formula C14H22N3O5
Exact Mass 312.155946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KN6RIQzX2hA
Name 3,5-Dimethoxy-4-hydroxy-benzoic acid, 4-guanidino-butyl ester cation
Comments hydrochloride
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H22N3O5
InChI InChI=1S/C14H21N3O5/c1-20-10-7-9(8-11(21-2)12(10)18)13(19)22-6-4-3-5-17-14(15)16/h7-8,18H,3-6H2,1-2H3,(H4,15,16,17)/p+1
InChIKey WNGSUWLDMZFYNZ-UHFFFAOYSA-O
Instrument Name Varian CFT-20
Literature Reference G.E. Langford, P. Yates, H.W.Yeung, Org. Magn. Resonance 14, 474 (1980).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O